In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 10th, 2010 | 30 | No |
Popular Name: N6-(2-morpholinoethyl)-5-nitro-N4-[4-(trifluoromethoxy)phenyl]pyrimidine-4,6-diamine N6-(2-morpholinoethyl)-5-nitro-N…
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 3.06 | 6.55 | -6.98 | 2 | 10 | 0 | 117 | 428.371 | 9 | ↓ |
Mid Mid (pH 6-8) | 3.06 | 8.82 | -43.57 | 3 | 10 | 1 | 119 | 429.379 | 9 | ↓ |
No pre-computed analogs available. Try a structural similarity search.